NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.1048 8.0544 120.3926 62.3674 33.4524 175.7130 3 E 4.3472 8.0855 116.4742 56.0159 31.4924 174.5097 4 R 4.1990 7.8983 117.9406 56.5105 28.3861 177.2860 5 T 4.6790 8.0931 113.5347 59.2889 70.9472 174.4391 6 A 4.5482 8.6008 128.4469 51.4506 19.4622 176.4068 7 V 4.3287 8.0499 119.8538 61.0002 34.7017 174.5378 8 F 4.7104 8.4863 124.6341 54.7141 42.6271 173.2105 9 P 4.4617 0.0000 0.0000 62.2266 31.8675 176.4923 10 A 4.1048 8.2560 124.2195 53.3904 19.2652 178.9409 11 G 3.7953 8.9392 108.9032 44.8819 0.0000 172.7613 12 R 4.5476 8.2837 117.8429 54.6447 31.5334 171.3535 13 H 4.6535 8.7459 120.1472 53.6844 31.0905 173.6012 14 S 4.7087 8.0296 122.2588 56.8872 62.4734 173.5315 15 L 4.7397 7.8481 122.0503 54.9226 47.5174 178.4714 16 Y 4.1168 7.8286 115.9451 60.6258 37.5908 177.9033 17 A 4.0386 7.9579 121.3812 55.0310 18.5947 179.0612 18 E 3.9674 8.2025 116.1082 59.2760 29.9268 177.7025 19 H 4.8256 8.5898 113.2021 54.1929 30.7807 174.9994 20 R 4.0768 7.5359 118.3532 56.1986 27.2739 174.6287 21 Y 4.9887 8.6493 115.1457 55.8302 41.4548 175.7496 22 S 3.9486 8.4357 117.3035 57.5149 64.2833 174.4899 23 A 3.5449 6.4502 124.6220 54.7415 19.2244 177.0707 24 A 4.8387 7.0582 114.2094 51.1621 23.6008 175.6047 25 I 4.8272 8.7657 119.8971 59.5464 40.5272 174.6911 26 R 4.7966 8.6721 128.1472 55.0247 31.9306 175.2966 27 S 4.6085 9.2727 121.2299 57.2128 65.0160 174.5179 28 G 3.9821 8.5538 120.9407 47.0814 0.0000 172.4540 29 D 5.6824 8.6979 123.5239 51.9892 39.6922 174.9906 30 L 5.0730 7.8134 118.5693 53.2096 46.1103 175.1745 31 L 4.9995 8.9399 124.4561 53.4140 44.7238 175.1020 32 F 4.7925 9.3490 126.7317 56.0212 39.8221 175.1136 33 V 4.5091 8.3293 125.0184 61.5591 32.9234 175.8635 34 S 4.5715 9.0533 124.2316 58.1375 63.6917 174.4401 35 G 4.0454 8.6541 109.1911 46.5142 0.0000 172.7435 36 Q 4.8458 8.9066 123.1534 54.3394 30.8740 175.1941 37 V 4.4965 7.9101 114.4599 59.1414 36.6504 175.4877 38 G 4.3699 8.5431 110.6516 45.2148 0.0000 172.4049 39 S 5.5277 7.8190 116.7532 56.8253 65.9409 175.6284 40 R 4.3689 8.7955 122.4559 55.2167 30.9123 177.0992 41 E 3.9654 8.7173 118.5825 59.2666 29.5595 177.7513 42 D 4.2778 8.0211 115.9175 53.7535 40.0505 177.0243 43 G 4.0762 8.2206 109.0104 45.3503 0.0000 173.6803 44 T 4.3783 8.3327 110.8297 59.5253 70.3023 172.8087 45 P 5.0417 0.0000 0.0000 62.2810 32.2233 175.5547 46 E 4.1456 8.5244 121.5964 55.3858 29.9468 174.5637 47 P 4.3895 0.0000 0.0000 65.8522 31.7360 177.0061 48 D 4.5163 7.9842 117.8526 53.9627 42.4599 175.8884 49 F 4.2417 8.9842 129.3007 61.7294 39.5204 176.7882 50 Q 3.6545 8.2076 118.4545 59.4379 28.6600 178.8113 51 Q 3.9767 8.0272 119.1790 58.7024 28.6368 178.2676 52 Q 3.9496 8.0914 120.8551 59.1114 29.0953 178.4368 53 V 2.9987 7.4368 119.3325 65.7863 31.4137 178.2743 54 R 3.9878 7.8369 117.8417 59.2337 29.9185 178.8202 55 L 4.0078 8.3136 120.2471 57.9362 41.9637 178.7670 56 A 4.1981 8.2474 122.4580 54.8078 18.2788 179.7103 57 F 4.1497 8.3170 116.2179 60.6315 38.9004 177.8010 58 D 4.4962 8.4656 118.7928 57.5677 40.6952 178.5048 59 N 4.4002 8.9337 117.3590 56.0532 38.4063 177.2230 60 L 3.9992 8.3854 122.1067 58.5379 42.2791 178.4216 61 H 3.8896 8.8415 118.1805 59.3033 29.7802 176.9743 62 A 4.0646 8.2980 122.5155 55.4525 16.7975 179.8354 63 T 3.8132 8.0419 114.2592 66.6008 68.4487 176.9720 64 L 4.0084 8.2302 121.0301 57.7872 41.7020 179.1996 65 A 3.9663 8.2709 120.7863 55.3857 18.0540 179.4646 66 A 4.2420 7.7064 116.8792 54.3236 18.4401 178.5372 67 A 4.5588 7.2422 116.8093 51.4377 19.7515 177.3889 68 G 3.7765 8.3904 106.0169 45.6756 0.0000 173.4317 69 C 4.7318 7.8500 117.2553 58.2199 30.2698 172.3040 70 T 4.4949 8.4837 110.1328 59.9513 71.8857 174.8345 71 F 4.7933 8.4006 118.7938 60.7678 38.9489 177.5177 72 D 4.6459 8.0187 119.1174 56.5426 40.8973 176.6885 73 D 4.6892 8.1844 118.1739 54.1838 41.3799 176.2423 74 I 4.3116 7.6910 121.8509 61.4244 37.2585 175.6995 75 I 4.4313 8.6962 118.4049 60.8682 39.2121 175.2461 76 D 4.8152 7.6088 122.3653 53.0609 45.0280 173.7409 77 V 4.5377 8.9017 124.9015 61.2682 35.0514 174.1835 78 T 4.8433 8.5029 123.7492 61.5865 72.4424 172.9874 79 S 4.6652 8.8832 120.7697 56.2532 66.3712 172.9335 80 F 5.2055 8.4161 120.4291 56.1257 42.3401 174.1364 81 H 5.4975 9.0589 118.6764 54.5362 32.3606 174.5885 82 T 4.4638 8.7083 112.0572 62.8461 70.0524 174.6646 83 D 4.9203 7.8928 120.1836 52.1710 42.5811 173.3985 84 P 4.3501 0.0000 0.0000 66.2099 31.8882 179.0761 85 E 4.1107 8.4783 117.1057 59.4478 29.3547 177.4978 86 N 4.6830 7.7367 112.5042 53.0856 38.7754 175.6143 87 Q 4.4844 7.6794 117.0714 55.1904 31.1166 177.7198 88 F 4.3660 8.1152 114.0650 59.9430 37.8074 177.1617 89 E 3.9802 7.2510 118.5892 59.2627 29.1540 178.8732 90 D 4.3665 7.9939 118.4253 57.4002 40.9888 178.7242 91 I 3.7045 8.0721 120.3188 64.7160 37.1611 178.4539 92 M 4.0390 8.5391 119.9467 58.4671 31.2588 178.7151 93 T 3.8007 7.8247 115.9952 66.8864 68.8118 176.7273 94 V 3.2741 7.4715 119.7499 65.6751 31.4744 177.9733 95 K 3.7793 8.3528 119.8882 59.4633 31.8844 178.1679 96 N 4.4905 8.3967 114.8645 54.8372 38.5509 176.2061 97 E 4.1607 7.1832 120.2905 58.3561 30.0785 177.7102 98 I 3.8468 7.1319 118.4704 62.5026 38.5739 176.7686 99 F 4.9483 7.9998 120.0230 55.9503 37.8526 175.4102 100 S 4.5079 8.3465 118.2638 60.1055 63.8669 175.4924 101 A 4.7473 7.7039 121.1504 48.9257 21.9637 173.5806 102 P 3.6722 0.0000 0.0000 61.1134 32.0166 174.4801 103 P 4.1337 0.0000 0.0000 62.8506 31.6087 176.1344 104 Y 4.4909 8.0296 120.8412 56.6593 38.6854 173.4430 105 P 4.4898 0.0000 0.0000 62.1766 32.3216 175.6814 106 N 4.8249 8.2448 116.5488 53.2345 39.1641 173.6430 107 W 4.4208 8.0104 124.0505 57.3569 33.7457 174.2931 108 T 4.7195 8.3437 122.2493 62.0019 71.6892 172.4633 109 A 5.3704 8.8534 128.3257 49.3364 21.3152 175.6069 110 V 4.4878 8.8858 122.2047 60.9437 35.6612 174.4406 111 G 4.4180 8.8418 113.8303 45.6677 0.0000 173.2548 112 V 4.8628 9.1904 118.9087 59.9016 35.2176 176.5667 113 T 4.3712 8.5895 110.3058 62.3496 69.6610 174.6677 114 W 5.0475 7.7893 129.6763 56.8064 33.7842 174.0398 115 L 4.0630 7.2544 123.5701 54.2784 42.1175 175.7540 116 A 3.1030 5.8000 114.2591 52.8704 16.3059 178.7727 117 G 3.7028 7.9432 108.6852 46.5033 0.0000 174.7147 118 F 4.5594 7.4432 117.7129 56.8586 39.9419 175.1170 119 D 5.1463 8.7158 118.7533 53.4675 42.6352 175.6163 120 F 5.2936 8.2997 119.8632 57.1733 42.7051 172.7950 121 E 4.6658 7.8949 124.9114 54.7244 33.7665 173.5332 122 I 4.4818 8.2484 125.6275 59.0640 41.1726 173.5640 123 K 4.7179 9.0482 132.0275 55.0589 33.8358 175.3630 124 V 4.8970 8.0223 123.1072 61.1411 35.7573 173.9395 125 I 4.9369 8.4022 125.0271 59.3786 40.5689 174.4615 126 A 5.2114 8.7837 128.0544 49.8788 22.6929 174.8179 127 R 4.5348 8.4388 117.0797 55.4465 31.0877 176.6062 128 I 4.3812 8.8084 124.5719 58.1366 38.8397 172.1874 129 P 4.3920 0.0000 0.0000 63.2278 31.9418 176.1913 130 E 4.3697 8.8528 124.4460 55.1773 29.3948 176.4916 131 Q 4.2085 8.3071 122.4039 55.8148 29.4204 175.9602 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 V 8.05 4.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.93 0.00 0.00 3 E 8.09 4.35 0.00 1.97 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.44 0.00 4 R 7.90 4.20 0.00 1.87 1.76 0.00 3.28 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 5 T 8.09 4.68 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 6 A 8.60 4.55 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.05 4.33 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.84 0.00 0.00 8 F 8.49 4.71 0.00 2.87 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.46 0.00 1.93 1.95 0.00 3.84 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.09 0.00 10 A 8.26 4.10 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 8.94 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.28 4.55 0.00 1.81 1.70 0.00 3.22 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.17 0.00 13 H 8.75 4.65 0.00 3.22 3.30 0.00 5.83 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.03 4.71 0.00 3.66 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.85 4.74 0.00 1.38 1.53 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.83 4.12 0.00 3.03 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.96 4.04 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 8.20 3.97 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.35 0.00 19 H 8.59 4.83 0.00 3.56 3.34 0.00 5.86 0.00 0.00 0.00 0.00 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 7.54 4.08 0.00 2.11 2.06 0.00 3.25 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.64 0.00 21 Y 8.65 4.99 0.00 3.17 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.44 3.95 0.00 3.66 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 6.45 3.54 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.06 4.84 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 8.77 4.83 1.93 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.98 0.92 0.00 0.00 26 R 8.67 4.80 0.00 1.88 1.77 0.00 3.01 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 27 S 9.27 4.61 0.00 3.85 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.55 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.70 5.68 0.00 2.81 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.81 5.07 0.00 1.60 1.02 0.99 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.94 5.00 0.00 1.60 1.47 0.90 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 32 F 9.35 4.79 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.33 4.51 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.90 0.00 0.00 34 S 9.05 4.57 0.00 4.03 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.65 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.91 4.85 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.61 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 37 V 7.91 4.50 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 -0.19 0.00 0.00 38 G 8.54 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.82 5.53 0.00 4.15 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.80 4.37 0.00 1.96 1.96 0.00 3.24 0.00 0.00 3.44 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 41 E 8.72 3.97 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.19 0.00 42 D 8.02 4.28 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.22 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.33 4.38 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 45 P 0.00 5.04 0.00 2.19 1.25 0.00 3.54 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.43 0.00 46 E 8.52 4.15 0.00 2.21 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 47 P 0.00 4.39 0.00 2.09 2.13 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 48 D 7.98 4.52 0.00 2.76 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.98 4.24 0.00 3.16 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.21 3.65 0.00 2.34 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 51 Q 8.03 3.98 0.00 2.31 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.58 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 52 Q 8.09 3.95 0.00 2.46 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.73 0.00 53 V 7.44 3.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 -0.22 0.00 0.00 54 R 7.84 3.99 0.00 2.05 1.97 0.00 3.32 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 55 L 8.31 4.01 0.00 1.85 1.86 0.98 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.25 4.20 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 8.32 4.15 0.00 3.33 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 8.47 4.50 0.00 2.97 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.93 4.40 0.00 2.88 3.04 0.00 0.00 6.70 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.39 4.00 0.00 1.87 2.11 0.99 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.84 3.89 0.00 3.36 3.39 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.30 4.06 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.04 3.81 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 64 L 8.23 4.01 0.00 1.73 1.67 1.13 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 65 A 8.27 3.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 7.71 4.24 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.24 4.56 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.39 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 C 7.85 4.73 0.00 3.03 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.48 4.49 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 71 F 8.40 4.79 0.00 3.22 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.02 4.65 0.00 2.72 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 8.18 4.69 0.00 2.85 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.69 4.31 2.10 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.73 0.87 0.00 0.00 75 I 8.70 4.43 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.55 0.94 0.00 0.00 76 D 7.61 4.82 0.00 2.63 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.90 4.54 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 0.51 0.00 0.00 78 T 8.50 4.84 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 79 S 8.88 4.67 0.00 3.69 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.42 5.21 0.00 2.85 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 9.06 5.50 0.00 3.19 3.50 0.00 5.61 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.71 4.46 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 83 D 7.89 4.92 0.00 2.72 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 4.35 0.00 2.35 2.46 0.00 3.84 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 85 E 8.48 4.11 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 86 N 7.74 4.68 0.00 2.69 2.71 0.00 0.00 6.91 8.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Q 7.68 4.48 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.80 0.00 0.00 0.00 0.00 0.00 1.38 2.17 0.00 88 F 8.12 4.37 0.00 3.20 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 7.25 3.98 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.86 0.00 90 D 7.99 4.37 0.00 3.12 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.07 3.70 2.15 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.21 1.16 0.00 0.00 92 M 8.54 4.04 0.00 2.00 2.24 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.46 0.00 93 T 7.82 3.80 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 94 V 7.47 3.27 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.85 0.00 0.00 95 K 8.35 3.78 0.00 1.84 1.75 0.00 0.61 0.00 0.00 1.10 0.00 0.00 2.54 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.74 7.81 96 N 8.40 4.49 0.00 2.67 2.82 0.00 0.00 6.98 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 E 7.18 4.16 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 98 I 7.13 3.85 0.94 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.31 -0.37 0.00 0.00 99 F 8.00 4.95 0.00 3.21 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 S 8.35 4.51 0.00 4.03 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.70 4.75 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 3.67 0.00 1.88 1.26 0.00 3.59 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 103 P 0.00 4.13 0.00 2.17 2.06 0.00 3.71 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 104 Y 8.03 4.49 0.00 3.03 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.49 0.00 1.97 1.78 0.00 3.69 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.53 0.00 106 N 8.24 4.82 0.00 2.75 2.92 0.00 0.00 5.82 8.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 W 8.01 4.42 0.00 3.37 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.34 4.72 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 109 A 8.85 5.37 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.89 4.49 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.96 0.00 0.00 111 G 8.84 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 V 9.19 4.86 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.13 0.00 0.00 113 T 8.59 4.37 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 114 W 7.79 5.05 0.00 3.19 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.25 4.06 0.00 1.81 1.43 1.03 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 116 A 5.80 3.10 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 7.94 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 7.44 4.56 0.00 3.09 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.72 5.15 0.00 3.03 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.30 5.29 0.00 3.35 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 7.89 4.67 0.00 1.90 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 122 I 8.25 4.48 1.47 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.15 0.69 0.00 0.00 123 K 9.05 4.72 0.00 2.02 1.68 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 124 V 8.02 4.90 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.84 0.00 0.00 125 I 8.40 4.94 1.71 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.59 0.34 0.00 0.00 126 A 8.78 5.21 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 R 8.44 4.53 0.00 1.78 1.89 0.00 3.04 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.81 0.00 128 I 8.81 4.38 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.70 0.89 0.00 0.00 129 P 0.00 4.39 0.00 2.06 2.00 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 130 E 8.85 4.37 0.00 1.82 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 131 Q 8.31 4.21 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.65 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00